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1-[(2S)-3-{[N-(Cyclohexylcarbonyl)-D-alanyl]sulfanyl}-2-methylpropanoyl]-L-proline | CAS No. 85856-54-8

1-[(2S)-3-{[N-(Cyclohexylcarbonyl)-D-alanyl]sulfanyl}-2-methylpropanoyl]-L-proline

Basic Information

Chemical_Structure_Of

CAS Number

85856-54-8

Molecular Formula

C19H30N2O5S

Molecular Weight

398.53 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Melting Point

113-116°

Boiling Point

658.9°C at 760 mmHg

Density

1.248

Flash Point

352.3°C

Refractive Index

1.553

Specific Rotation

D +14.2° (c = 1.05 in methanol)

SMILES

CC(CSC(=O)C(C)NC(=O)C1CCCCC1)C(=O)N2CCCC2C(=O)O

InChI

InChI=1S/C19H30N2O5S/c1-12(17(23)21-10-6-9-15(21)18(24)25)11-27-19(26)13(2)20-16(22)14-7-4-3-5-8-14/h12-15H,3-11H2,1-2H3,(H,20,22)(H,24,25)/t12-,13-,15+/m1/s1

InChIKey

QIJLJZOGPPQCOG-NFAWXSAZSA-N

LogP

2.0429

Topological Polar Surface Area

103.78000000000002 Å²

Hydrogen Bond Donor/Acceptor

2 / 7

Complexity

576

Synonyms & References

English

Q27283128
MOVELTIPRIL [MI]
LQI0441316
DTXSID4023337
1-[(2S)-3-{[N-(cyclohexylcarbonyl)-D-alanyl]thio}-2-methylpropanoyl]-L-proline
Moveltipril [INN]
Moveltipril
UNII-LQI0441316
MOVELTIPRIL [WHO-DD]
AKOS040747182
HY-116023
MOVELTIPRIL [MART.]
MS-26746
(-)-1-((2S)-3-Mercapto-2-methylpropionyl)-L-proline, ester with N-(cyclohexyl-carbonyl)thio-D-alanine.
(-)-1-((2S)-3-Mercapto-2-methylpropionyl)-L-proline, ester with N-(cyclohexylcarbonyl)thio-D-alanine
CS-0063545
CHEMBL2105197
85856-54-8
(2S)-1-[(2S)-3-[(2R)-2-(cyclohexanecarbonylamino)propanoyl]sulfanyl-2-methylpropanoyl]pyrrolidine-2-carboxylic acid
Altiopril
SCHEMBL187264
(2R)-1-[(2R)-3-[2-(Cyclohexanecarbonylamino)propanoylsulfanyl]-2-methylpropanoyl]pyrrolidine-2-carboxylic acid

MDL Number

MFCD00865956

Related Compounds

1,3-Dibromo-2,4-dichloro-5-fluorobenzene structure

1,3-Dibromo-2,4-dichloro-5-fluorobenzene

CAS Number: 1000573-45-4

Molecular Formula: C6HFCl2Br2

N-(2-Methoxyphenyl)-N-[(4-methylphenyl)sulfonyl]-beta-alanine structure

N-(2-Methoxyphenyl)-N-[(4-methylphenyl)sulfonyl]-beta-alanine

CAS Number: 103687-96-3

Molecular Formula: C17H19NO5S

5'-O-[Bis(4-methoxyphenyl)(phenyl)methyl]cytidine structure

5'-O-[Bis(4-methoxyphenyl)(phenyl)methyl]cytidine

CAS Number: 112897-99-1

Molecular Formula: C30H31N3O7

Darunavir-d9 structure

Darunavir-d9

CAS Number: 1133378-37-6

Molecular Formula: C27H28D9N3O7S

2-Bromo-3-isopropoxypyridine structure

2-Bromo-3-isopropoxypyridine

CAS Number: 113503-65-4

Molecular Formula: C8H10BrNO

Methyl 6-fluoro-4-oxo-4H-chromene-2-carboxylate structure

Methyl 6-fluoro-4-oxo-4H-chromene-2-carboxylate

CAS Number: 116543-91-0

Molecular Formula: C11H7FO4

(3S,4R)-3-Hydroxy-2,2-dimethyl-4-[(3-oxo-1-cyclopenten-1-yl)oxy]-6-chromanecarbonitrile structure

(3S,4R)-3-Hydroxy-2,2-dimethyl-4-[(3-oxo-1-cyclopenten-1-yl)oxy]-6-chromanecarbonitrile

CAS Number: 121055-10-5

Molecular Formula: C17H17NO4

Methyl 5-chloropyrazolo[1,5-a]pyrimidine-2-carboxylate structure

Methyl 5-chloropyrazolo[1,5-a]pyrimidine-2-carboxylate

CAS Number: 1263059-26-2

Molecular Formula: C8H6ClN3O2

8-Bromoisoquinolin-1-amine structure

8-Bromoisoquinolin-1-amine

CAS Number: 1337879-85-2

Molecular Formula: C9H7BrN2

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Supplier Information

Tianshi Group

CAS Number: 85856-54-8

MedChemExpress LLC

CAS Number: 85856-54-8

ShenZhenAiTaHuaXue Co Ltd

CAS Number: 85856-54-8

Hubei Janmintai Huaheight Chemical Co., Ltd.

CAS Number: 85856-54-8

ShenZhenShiRuiJiTe Biotechnology Co Ltd

CAS Number: 85856-54-8

AiFChem, an XtalPi company

CAS Number: 85856-54-8